BMRB Entry 4391

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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR4391
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Title:
Isolation, purification, 1H NMR assignments and secondary structure characterization of a neurotoxin from Bungarus candidus
Deposition date:
1999-09-08
Original release date:
2000-08-07
Authors:
Venkitakrishnan, Rani; Chary, Kandala
Citation:

Citation: Venkitakrishnan, Rani; Chary, Kandala. "Isolation, purification, 1H NMR assignments and secondary structure characterization of a neurotoxin from Bungarus candidus"  .

Assembly members:

Assembly members:
long neurotoxin, polymer, 66 residues, 7334.67 Da.

Natural source:

Natural source:   Common Name: Malayan Krait   Taxonomy ID: 92438   Superkingdom: Eukaryota   Kingdom: Metazoa   Genus/species: Bungarus candidus

Experimental source:

Experimental source:   Production method: purified from the natural source

Entity Sequences (FASTA):

Entity Sequences (FASTA):
long neurotoxin: MKCKICNFDTCRAGELKVCA SGEKYCFKESWREARGTRIE RGCAATCPKGSVYGLYVLCC TTDDCN

Data sets:
  • assigned_chemical_shifts
Data typeCount
13C chemical shifts182
15N chemical shifts66
1H chemical shifts411

Additional metadata:

  • Assembly
  • Samples and Experiments
  • Software
  • Spectrometers
  • Hide all

Assembly:

Entity Assembly IDEntity NameEntity ID
1candoxin1

Entities:

Entity 1, candoxin 66 residues - 7334.67 Da.

1   METLYSCYSLYSILECYSASNPHEASPTHR
2   CYSARGALAGLYGLULEULYSVALCYSALA
3   SERGLYGLULYSTYRCYSPHELYSGLUSER
4   TRPARGGLUALAARGGLYTHRARGILEGLU
5   ARGGLYCYSALAALATHRCYSPROLYSGLY
6   SERVALTYRGLYLEUTYRVALLEUCYSCYS
7   THRTHRASPASPCYSASN

Samples:

sample_1: long neurotoxin 4 mM

condition-1: pH: 3; temperature: 298 K

Experiments:

NameSampleSample stateSample conditions

Software:

No software information available

NMR spectrometers:

    Related Database Links:

    PDB
    EMBL CAA06886 CAA35776 CAD56380
    GB AAN16112 ADN67590
    SP P15818 P81783
    AlphaFold P15818 P81783

    Download HSQC peak lists in one of the following formats:
    CSV: Backbone or all simulated peaks
    SPARKY: Backbone or all simulated peaks